6-fluoranyl-1-(2-fluoranylcyclopropyl)-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-1-(2-fluoranylcyclopropyl)-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-1-(2-fluorocyclopropyl)-7-(2-methylisoindolin-5-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-fluoro-1-(2-fluorocyclopropyl)-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-1-(2-fluorocyclopropyl)-7-(2-methyl-1,3-dihydroisoindol-5-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-fluoro-1-(2-fluorocyclopropyl)-4-keto-7-(2-methylisoindolin-5-yl)quinoline-3-carboxylic acid Formula: C22H18F2N2O3 MolecularWeight: 396.386726

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(C1)C=C(C=C2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5F)F

Isomeric SMILES

CN1CC2=C(C1)C=C(C=C2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5F)F

InChI

InChI=1S/C22H18F2N2O3/c1-25-8-12-3-2-11(4-13(12)9-25)14-6-19-15(5-17(14)23)21(27)16(22(28)29)10-26(19)20-7-18(20)24/h2-6,10,18,20H,7-9H2,1H3,(H,28,29)